In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 21 | Yes |
Popular Name: N-(2-cyanoethyl)-N-methyl-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propanamide N-(2-cyanoethyl)-N-methyl-3-[3-(…
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Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.02 | 4.41 | -15.67 | 0 | 7 | 0 | 96 | 285.307 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.02 | 4.86 | -49.42 | 1 | 7 | 1 | 97 | 286.315 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.